ethyl 5-azanyl-4-cyano-3-(cyclohexylsulfanylmethyl)thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-(cyclohexylsulfanylmethyl)thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-(cyclohexylsulfanylmethyl)thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[(cyclohexylthio)methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-(cyclohexylsulfanylmethyl)thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(cyclohexylthio)methyl]thiophene-2-carboxylic acid ethyl ester Formula: C15H20N2O2S2 MolecularWeight: 324.4615

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2CCCCC2

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2CCCCC2

InChI

InChI=1S/C15H20N2O2S2/c1-2-19-15(18)13-12(11(8-16)14(17)21-13)9-20-10-6-4-3-5-7-10/h10H,2-7,9,17H2,1H3